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	hartrees
Energy at 0K	-169.591057
Energy at 298.15K	-169.595068
HF Energy	-168.972367
Nuclear repulsion energy	70.963915

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3920	3739	84.66
2	A'	3576	3410	10.34
3	A'	3097	2954	38.06
4	A'	1772	1690	200.36
5	A'	1440	1373	14.46
6	A'	1353	1290	164.60
7	A'	1208	1152	43.30
8	A'	1078	1028	200.06
9	A'	620	592	1.20
10	A"	1051	1003	2.92
11	A"	844	805	61.00
12	A"	400	381	70.08

Atom	x (Å)	y (Å)
C1	0.000	0.375
O2	-1.003	-0.529
N3	1.196	-0.020
H4	-0.329	1.417
H5	-1.844	-0.073
H6	1.820	0.780

	C1	O2	N3	H4	H5	H6
C1		1.3504	1.2598	1.0922	1.8981	1.8645
O2	1.3504		2.2574	2.0595	0.9574	3.1116
N3	1.2598	2.2574		2.0950	3.0413	1.0143
H4	1.0922	2.0595	2.0950		2.1253	2.2409
H5	1.8981	0.9574	3.0413	2.1253		3.7624
H6	1.8645	3.1116	1.0143	2.2409	3.7624

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	H5	109.490	C1	N3	H6	109.672
O2	C1	N3	119.688	O2	C1	H4	114.535
N3	C1	H4	125.777

All results from a given calculation for HOCHNH (hydroxymethylimine)

using model chemistry: QCISD/6-311+G(3df,2p)

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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